CID 86683169

N-tert-butyl-1-formylcyclopropane-1-sulfonamide

Structural Information

Molecular Formula
C8H15NO3S
SMILES
CC(C)(C)NS(=O)(=O)C1(CC1)C=O
InChI
InChI=1S/C8H15NO3S/c1-7(2,3)9-13(11,12)8(6-10)4-5-8/h6,9H,4-5H2,1-3H3
InChIKey
HWRWXSHAVJWSCE-UHFFFAOYSA-N
Compound name
N-tert-butyl-1-formylcyclopropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

205.07727 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.08455 142.4
[M+Na]+ 228.06649 151.3
[M-H]- 204.06999 147.1
[M+NH4]+ 223.11109 158.6
[M+K]+ 244.04043 149.3
[M+H-H2O]+ 188.07453 138.3
[M+HCOO]- 250.07547 159.2
[M+CH3COO]- 264.09112 186.4
[M+Na-2H]- 226.05194 149.2
[M]+ 205.07672 148.4
[M]- 205.07782 148.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe